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Pre-chamber combustion (PCC) engines allow extending the lean limit of operation compared to common SI engines, thus being a candidate concept for the future clean transportation targets. To understand the fundamental mechanisms of the main chamber charge ignition in PCC engines, the effects of the composition in the pre-chamber were investigated numerically. A well-stirred reactor combustion model coupled with a methane oxidation mechanism reduced from GRI 3.0 was used. An open-cycle simulation was run with initialization at exhaust valve opening (EVO). For posterior simulations, the initial flow field was attained by mapping the field variables obtained from the full cycle simulation. The entire simulation domain (pre-chamber and main chamber) global excess air ratio (λ) was set to 1.3.

Super-knock that occurs in spark ignition (SI) engines is investigated using two-dimensional (2D) numerical simulations. The temperature, pressure, velocity, and mixture distributions are obtained and mapped from a top dead center (TDC) slice of full-cycle three-dimensional (3D) engine simulations. Ignition is triggered at one end of the cylinder and a hot spot of known temperature was used to initiate a pre-ignition front to study super-knock. The computational fluid dynamics code CONVERGE was used for the simulations. A minimum grid size of 25 μm was employed to capture the shock wave and detonation inside the domain. The Reynolds-averaged Navier-Stokes (RANS) method was employed to represent the turbulent flow and gas-phase combustion chemistry was represented using a reduced chemical kinetic mechanism for primary reference fuels. A multi-zone model, based on a well-stirred reactor assumption, was used to solve the reaction terms.

The purpose of present numerical study was to extend the operating range of alcohol (methanol and ethanol) fueled Homogeneous Charge Compression Ignition (HCCI) engine under low load conditions. Ignition of pure methanol and ethanol under HCCI mode of operation requires high intake temperatures and misfires at low loads are common in HCCI engines. Three methods have been adapted to optimize the use of methanol and ethanol for HCCI operation without increasing the intake temperature. First, blending methanol and ethanol with ignition improver, namely di-methyl ether (DME) and di-ethyl ether (DEE), was used to increase the cetane number and ignitability of premixed charge. Second, based on the blended fuels, the spark assistance was used to reduce required intake temperature for auto-ignition. Third, DME and DEE were directly injected to methanol and ethanol operated HCCI engine, in the form of Reactivity Controlled Compression Ignition (RCCI) combustion.

To elucidate the complex characteristics of pre-chamber combustion engines, the interaction of the hot gas jets initiated by an active narrow throated pre-chamber with lean premixed CH4/air in a heavy-duty engine was studied computationally. A twelve-hole KAUST proprietary pre-chamber geometry was investigated using CONVERGE software. The KAUST pre-chamber has an upper conical part with the spark plug, and fuel injector, followed by a straight narrow region called the throat and nozzles connecting the chambers. The simulations were run for an entire cycle, starting at the previous cycle's exhaust valve opening (EVO). The SAGE combustion model was used with the chemistry modeled using a reduced methane oxidation mechanism based on GRI Mech 3.0, which was validated against in-house OH chemiluminescence data from the optical engine experiments.

To provide insights into the fundamental characteristics of pre-chamber combustion engines, the ignition of lean premixed CH4/air due to hot gas jets initiated by a passive narrow throated pre-chamber in a heavy-duty engine was studied computationally. A twelve-hole pre-chamber geometry was investigated using CONVERGETM software. The numerical model was validated against the experimental results. To elucidate the main-chamber ignition mechanism, the spark plug location and spark timing were varied, resulting in different pressure gradient during turbulent jet formation. Different ignition mechanisms were observed for turbulent jet ignition of lean premixed CH4/air, based on the geometry effect. Ignition behavior was classified into the flame and jet ignition depending on the significant presence of hot active radicals. The jet ignition, mainly due to hot product gases was found to be advanced by the addition of a small concentration of radicals.

Heavy-duty vehicles face increasing demands of emission regulations. Reduced carbon-dioxide (CO2) emission targets motivate decreased fuel consumption for fossil fuel engines. Increased engine efficiency contributes to lower fuel consumption and can be achieved by lower heat transfer, friction and exhaust losses. The double compression expansion engine (DCEE) concept achieves higher efficiency, as it utilizes a split-cycle approach to increase the in-cylinder pressure and recover the normally wasted exhaust energy. However, the DCEE concept suffers heat losses from the high-pressure approach. This study utilizes up to three injectors to reduce the wall-gas temperature gradient rendering lower convective heat losses. The injector configuration consists of a standard central injector and two side-injectors placed at the rim of the bowl. An increased distance from side-injector to the wall delivered lower heat losses by centralizing hot gases in the combustion chamber.

Opposed-piston two-stroke engines offer numerous advantages over conventional four-stroke engines, both in terms of fundamental principles and technical aspects. The reduced heat losses and large volume-to-surface area ratio inherently result in a high thermodynamic efficiency. Additionally, the mechanical design is simpler and requires fewer components compared to conventional four-stroke engines. When combining this engine concept with alternative fuels such as hydrogen and pre-chamber technology, a potential route for carbon-neutral powertrains is observed. To ensure safe engine operation using hydrogen as fuel, it is crucial to consider strict safety measures to prevent issues such as knock, pre-ignition, and backfiring. One potential solution to these challenges is the use of direct injection, which has the potential to improve engine efficiency and expand the range of load operation.

Alcohols are potential blending agents for diesel that can be effectively used in compression ignition engines. This work investigates the use of n-butanol as a blending component for diesel fuel using experiments and simulations. Dodecane was selected as a surrogate for diesel fuel and various concentrations of n-butanol were added to study ignition characteristics. Ignition delay times for different n-butanol/dodecane blends were measured using the ignition quality tester at KAUST (KR-IQT). The experiments were conducted at pressure of 21 and 18 bar, temperature ranging from 703-843 K and global equivalence ratio of 0.85. A skeletal mechanism for n-dodecane and n-butanol blends with 203 species was developed for numerical simulations. The mechanism was developed by combining n-dodecane skeletal mechanism containing 106 species and a detailed mechanism for all the butanol isomers.

Numerical simulations were conducted to systematically assess the effects of different spray models on the ignition delay predictions and compared with experimental measurements obtained at the KAUST ignition quality tester (IQT) facility. The influence of physical properties and chemical kinetics over the ignition delay time is also investigated. The IQT experiments provided the pressure traces as the main observables, which are not sufficient to obtain a detailed understanding of physical (breakup, evaporation) and chemical (reactivity) processes associated with auto-ignition. A three-dimensional computational fluid dynamics (CFD) code, CONVERGE™, was used to capture the detailed fluid/spray dynamics and chemical characteristics within the IQT configuration. The Reynolds-averaged Navier-Stokes (RANS) turbulence with multi-zone chemistry sub-models was adopted with a reduced chemical kinetic mechanism for n-heptane and iso-octane.

Earlier studies on efficiency improvement in CI engines have suggested that heat transfer losses contribute largely to the total energy losses. Fuel impingement on the cylinder walls is typically associated with high heat transfer. This study proposes a two-injector concept to reduce heat losses and thereby improve efficiency. The two injectors are placed at the rim of the bowl to change the spray pattern. Computational simulations based on the Reynolds-Averaged Navier-Stokes approach have been performed for four different fuel injection timings in order to quantify the reduction in heat losses for the proposed concept. Two-injector concepts were compared to reference cases using only one centrally mounted injector. All simulations were performed in a double compression expansion engine (DCEE) concept using the Volvo D13 single-cylinder engine. In the DCEE, a large portion of the exhaust energy is re-used in the second expansion, thus increasing the thermodynamic efficiency.

This paper investigated the spray characteristics of methanol under the flash and non-flash boiling conditions defined by the Engine Combustion Network (ECN) Spray G. As a counterpart, the spray features of iso-octane were also simulated and compared to methanol. The Volume of Fluid (VOF) approach under the Eulerian scheme was employed to model the internal nozzle flow details, which information was used to initialize the spray parcels and taken as input for the Lagrangian simulations, namely, the one-way coupling method. Since the Eulerian high-fidelity simulations allow capturing the effects of the flow inside the non-symmetrical injector, the rate of injection (ROI) profile, discharge coefficient, and plume angle et al. are not required for the Lagrangian simulations. The simulation results show that the flash boiling led to longer penetrations and higher evaporation compared to the non-flash boiling condition for both fuels.

Typical automotive emission testing systems usually employ Flame Ionization Detection (FID) analyzers to measure unburned fuel species in the exhaust, but the technique is not suitable for engines operating on alcohol fuels. The FID method is not sensitive to measuring unburned alcohol fuels due to the presence of oxygen bonds in the fuel molecule. Other techniques, such as Fourier Transform Infrared (FTIR), can provide accurate unburned fuel measurements with alcohol fuel. However, these techniques are expensive and are less accessible compared to FID analyzers. In this study, the unburned fuel emissions from the engine exhaust were measured simultaneously with FID and FTIR analyzers, with the engine operating on pure alcohols, which are methanol, ethanol, and n-butanol. While most previous work focuses on stoichiometric air-fuel mixtures, a wide range of lean operating conditions between global-λ 1.6 to 2.8 will be tested in this study.

Partially premixed combustion (PPC) is an operating mode that lies between the conventional compression ignition (CI) mode and homogeneous charge compression ignition (HCCI) mode. The combustion in this mixed mode is complex as it is neither diffusion-controlled (CI mode) nor governed solely by chemical kinetics (HCCI mode). In this study, CFD simulations were performed to evaluate flame index, which distinguishes between zones having a premixed flame and non-premixed flame. Experiments performed in the optical engine supplied data to validate the model. In order to realize PPC, the start of injection (SOI) was fixed at −40 CAD (aTDC) so that a required ignition delay is created to premix air/fuel mixture. The reference operating point was selected to be with 3 bar IMEP and 1200 rpm. Naphtha with a RON of 77 and its corresponding PRF surrogate were tested. The simulations captured the general trends observed in the experiments well.

To understand key practical aspects of ammonia as a fuel for internal combustion engines, three-dimensional computational fluid dynamics (CFD) simulations were performed using CONVERGETM. A light-duty single-cylinder research engine with a geometrical compression ratio of 11.5 and a conventional pentroof combustion chamber was experimentally operated at stoichiometry. The fumigated ammonia was introduced at the intake plenum. Upon model validation, additional sensitivity analysis was performed. The combustion was modeled using a detailed chemistry solver (SAGE), and the ammonia oxidation was computed from a 38-specie and 262-reaction chemical reaction mechanism. Three different piston shapes were assessed, and it was found that the near-spark flow field associated with the piston design in combination with the tumble motion promotes faster combustion and yields enhanced engine performance.

The high-pressure isobaric combustion has been proposed as the most suitable combustion mode for the double compre4ssion expansion engine (DCEE) concept. Previous experimental and simulation studies have demonstrated an improved efficiency compared to the conventional diesel combustion (CDC) engine. In the current study, isobaric combustion was achieved using a single injector with multiple injections. Since this concept involves complex phenomena such as spray to spray interactions, the computational models were extensively validated against the optical engine experiment data, to ensure high-fidelity simulations. The considered optical diagnostic techniques are Mie-scattering, fuel tracer planar laser-induced fluorescence (PLIF), and natural flame luminosity imaging. Overall, a good agreement between the numerical and experimental results was obtained.

A numerical study has been conducted to investigate possible extension of the low load limit of the HCCI operating range by charge stratification using direct injection. A wide range of SOI timings at a low load HCCI engine operating condition were numerically examined to investigate the effect of DI. A multidimensional CFD code KIVA3v with a turbulent combustion model based on a modified flamelet approach was used for the numerical study. The CFD code was validated against experimental data by comparing pressure traces at different SOI’s. A parametric study on the effect of SOI on combustion has been carried out using the validated code. Two parameters, the combustion efficiency and CO emissions, were chosen to examine the effect of SOI on combustion, which showed good agreement between numerical results and experiments. Analysis of the in-cylinder flow field was carried out to identify the source of CO emissions at various SOI’s.

Full cycle simulations of KAUST optical diesel engine were conducted in order to provide insights into the details of fuel spray, mixing, and combustion characteristics at different start of injection (SOI) conditions. Although optical diagnostics provide valuable information, the high fidelity simulations with matched parametric conditions improve fundamental understanding of relevant physical and chemical processes by accessing additional observables such as the local mixture distribution, intermediate species concentrations, and detailed chemical reaction rates. Commercial software, CONVERGE™, was used as the main simulation tool, with the Reynolds averaged Navier-Stokes (RANS) turbulence model and the multi-zone (SAGE) combustion model to compute the chemical reaction terms. SOI is varied from late compression ignition (CI) to early partially premixed combustion (PPC) conditions.

The standard capability of engine experimental studies is that ensemble averaged quantities like in-cylinder pressure from multiple cycles and emissions are reported and the cycle to cycle variation (CCV) of indicated mean effective pressure (IMEP) is captured from many consecutive combustion cycles for each test condition. However, obtaining 3D spatial distribution of all the relevant quantities such as fuel-air mixing, temperature, turbulence levels and emissions from such experiments is a challenging task. Computational Fluid Dynamics (CFD) simulations of engine flow and combustion can be used effectively to visualize such 3D spatial distributions. A dual fuel engine is considered in the current study, with manifold injected natural gas (NG) and direct injected diesel pilot for ignition.

Ongoing development of a CFD framework for the simulation of primary atomization of a high pressure diesel jet is presented in this work. The numerical model is based on a second order accurate, polyhedral Finite Volume (FV) method implemented in foam-extend-4.1, a community driven fork of the OpenFOAM software. A geometric Volume-of-Fluid (VOF) method isoAdvector is used for interface advection, while the Ghost Fluid Method (GFM) is used to handle the discontinuity of the pressure and the pressure gradient at the interface between the two phases: n-dodecane and air in the combustion chamber. In order to obtain highly resolved interface while minimizing computational time, an Adaptive Grid Refinement (AGR) strategy for arbitrary polyhedral cells is employed in order to refine the parts of the grid near the interface. Dynamic Load Balancing (DLB) is used in order to preserve parallel efficiency during AGR.

Pre-ignition in SI engine is a critical issue that needs addressing as it may lead to super knock event. It is widely accepted that pre-ignition event emanates from hot spot(s) that can be anywhere inside the combustion chamber. The location and timing of hotspot is expected to influence the knock intensity from a pre-ignition event. In this study, we study the effect of location and timing of hot spot inside the combustion chamber using numerical simulations. The simulation is performed using a three-dimensional computational fluid dynamics (CFD) code, CONVERGE™. We simulate 3-D engine geometry coupled with chemistry, turbulence and moving structures (valves, piston). G-equation model for flame tracking coupled with multi-zone model is utilized to capture auto-ignition (knock) and solve gas phase kinetics. A parametric study on the effect of hot spot timing and location inside the combustion chamber is performed.